Glycoside
GD101280
Name:
NoneFormula:
C24H28O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(-c3cnc(-c4ccccc4)nc3)cn2C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1cc(-c2cnc(-c3ccccc3)nc2)cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 468.51 | Num_heavy_atoms: | 34 |
| TPSA: | 138.96 | NumAromaticRings: | 3 |
Unique Aglycone
AD42848
Formula: C18H18O2N4
Smiles:
Cn1cc(-c2cnc(-c3ccccc3)nc2)cc1C(=O)NCCO| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.37 | Num_heavy_atoms: | 24 |
| TPSA: | 80.04 | NumAromaticRings: | 3 |
